Cas no 30709-73-0 (2-butyl-1,3-thiazole-5-carboxylic acid)

2-butyl-1,3-thiazole-5-carboxylic acid structure
30709-73-0 structure
Product Name:2-butyl-1,3-thiazole-5-carboxylic acid
CAS No:30709-73-0
MF:C8H11NO2S
MW:185.24344086647
CID:313077
PubChem ID:19885513
Update Time:2025-04-19

2-butyl-1,3-thiazole-5-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 5-Thiazolecarboxylicacid, 2-butyl-
    • 2-butyl-1,3-thiazole-5-carboxylic acid
    • 2-Butyl-5-thiazolecarboxylicacid
    • RU 22155
    • EN300-1147512
    • Z1262513689
    • AKOS017531994
    • DTXSID50601006
    • 30709-73-0
    • 5-Thiazolecarboxylic acid, 2-butyl-
    • SCHEMBL3280971
    • 2-Butylthiazole-5-carboxylicacid
    • 2-Butylthiazole-5-carboxylic acid
    • Inchi: 1S/C8H11NO2S/c1-2-3-4-7-9-5-6(12-7)8(10)11/h5H,2-4H2,1H3,(H,10,11)
    • InChI Key: BNKZFUBCZHESJT-UHFFFAOYSA-N
    • SMILES: S1C(C(=O)O)=CN=C1CCCC

Computed Properties

  • Exact Mass: 185.05113
  • Monoisotopic Mass: 185.05104977g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 4
  • Complexity: 163
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.5
  • Topological Polar Surface Area: 78.4?2

Experimental Properties

  • PSA: 50.19

2-butyl-1,3-thiazole-5-carboxylic acid Pricemore >>

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